N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-pyridin-3-yl-propanamide

Systemtic Name: N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-pyridin-3-yl-propanamide Openeye Name: N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-(3-pyridyl)propanamide CAS Name: N-[[1-[2-(4-chlorophenyl)ethyl]-4-piperidin-1-iumyl]methyl]-N-methyl-3-(3-pyridinyl)propanamide IUPAC Name: N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-pyridin-3-ylpropanamide Traditional Name: N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-(3-pyridyl)propionamide Formula: C23H31ClN3O+ MolecularWeight: 400.96474

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CC[NH+](CC1)CCC2=CC=C(C=C2)Cl)C(=O)CCC3=CN=CC=C3

Isomeric SMILES

CN(CC1CC[NH+](CC1)CCC2=CC=C(C=C2)Cl)C(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C23H30ClN3O/c1-26(23(28)9-6-20-3-2-13-25-17-20)18-21-11-15-27(16-12-21)14-10-19-4-7-22(24)8-5-19/h2-5,7-8,13,17,21H,6,9-12,14-16,18H2,1H3/p+1